3-(5-bromanylthiophen-2-yl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide Openeye Name: 3-(5-bromo-2-thienyl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide CAS Name: 3-(5-bromo-2-thiophenyl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-propenamide IUPAC Name: 3-(5-bromothiophen-2-yl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide Traditional Name: 3-(5-bromo-2-thienyl)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acrylamide Formula: C16H11BrN2O3S MolecularWeight: 391.23914

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C(=CC3=CC=C(S3)Br)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C(=CC3=CC=C(S3)Br)C#N

InChI

InChI=1S/C16H11BrN2O3S/c17-15-4-2-12(23-15)7-10(9-18)16(20)19-11-1-3-13-14(8-11)22-6-5-21-13/h1-4,7-8H,5-6H2,(H,19,20)